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2,5-Ethenocyclopent[d]oxocin-9a(4H)-ol, 1,2,5,6,6a,7,8,9-octahydro-1-iodo-2,5,7-trimethyl-, (1.alpha.,2.alpha.,5.alpha.,6a.alpha.,7.alpha.,9a.beta.)-(.+-.)-
SpectraBase Compound ID JF22kGDzMkY
InChI InChI=1S/C15H23IO2/c1-10-4-5-15(17)11(10)8-13(2)6-7-14(3,12(15)16)18-9-13/h6-7,10-12,17H,4-5,8-9H2,1-3H3/t10-,11+,12-,13-,14+,15-/m0/s1
InChIKey XYWMQQLRCSMYGO-HGPDSQILSA-N
Mol Weight 362.25 g/mol
Molecular Formula C15H23IO2
Exact Mass 362.074275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HGI03GGRS5X
Name 2,5-Ethenocyclopent[d]oxocin-9a(4H)-ol, 1,2,5,6,6a,7,8,9-octahydro-1-iodo-2,5,7-trimethyl-, (1.alpha.,2.alpha.,5.alpha.,6a.alpha.,7.alpha.,9a.beta.)-(.+-.)-
Alternate Name(s) (1R,3R,4S,7S,8R,9R)-8-iodo-1,4,9-trimethyl-10-oxatricyclo[7.2.2.0(3,7)]tridec-12-en-7-ol 3,6,9-Trimethyl-2-iodo-1-hydroxy-3,6-epoxymethabicyclo[6.3.0]undeca-4-ene
CAS Registry Number 129918-62-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23IO2
InChI InChI=1S/C15H23IO2/c1-10-4-5-15(17)11(10)8-13(2)6-7-14(3,12(15)16)18-9-13/h6-7,10-12,17H,4-5,8-9H2,1-3H3/t10-,11+,12-,13-,14+,15-/m0/s1
InChIKey XYWMQQLRCSMYGO-HGPDSQILSA-N
Molecular Weight 362.251 g/mol
SMILES O[C@@]12[C@]([C@@]3(OC[C@](C[C@@]2([C@@](C)(CC1)[H])[H])(C=C3)C)C)(I)[H]
SPLASH splash10-0a4i-0090000000-6ac2066407d6233eec00
Source of Spectrum C-112-8495-29
Wiley ID 1349316